SCHEMBL16308952

SCHEMBL16308952

CCCOCOCCC1CO1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 4/20 0.45
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 2/20 0.37
SPHK2 Q9NRA0 1/20 0.36
MAPK1 P28482 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3623720 0.91
SCHEMBL2831526 0.89 MEN1 (0.46) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL6751288 0.83 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL11193807 0.82 MEN1 (0.46) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL5535311 0.80
SCHEMBL1499263 0.79
SCHEMBL3619783 0.78 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL7924840 0.78 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL3624389 0.78 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL25182060 0.78 MEN1 (0.53) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140370313-A1 NOVEL ADHESION PROMOTING AGENTS FOR METALLIZATION OF SUBSTRATE SURFACES ATOTECH USA, LLC 2014-12-18 US disclosed